Vitas-M small molecule compound
5-[4-(methylsulfonyl)piperazin-1-yl]-2-nitro-N-(4-phenylbutan-2-yl)aniline
Catalog ID
STK730221
SMILES CC(Nc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)C)CCc1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H28N4O4S MW 432.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O4S/c1-17(8-9-18-6-4-3-5-7-18)22-20-16-19(10-11-21(20)25(26)27)23-12-14-24(15-13-23)30(2,28)29/h3-7,10-11,16-17,22H,8-9,12-15H2,1-2H3InChIKey
MYHATGYCPPREHL-UHFFFAOYSA-NSynonyms
5(4(methylsulfonyl)piperazin1yl)2nitroN(4phenylbutan2yl)aniline
5(4METHYLSULFONYLPIPERAZIN1YL)2NITRON(4PHENYLBUTAN2YL)ANILINE
CC(CCC1=CC=CC=C1)NC2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C)(N+)(=O)(O)
CC(Nc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)C)CCc1ccccc1
InChI=1SC21H28N4O4Sc117(89186435718)22201619(101121(20)25(26)27)23121424(151323)30(228)29h371011161722H891215H212H3
MFCD02218767
ZINC000008855099
ZINC000008855100
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